LEAD BASIS SETS FOR THE CRYSTAL PROGRAM ======================================= TCM CRYSTAL basis set library: https://vallico.net/mike_towler/crystal.html Title: Lead [Durand-Barthelet pseudopotential] Comments: Pseudopotential ionic basis set optimized for the cation in PbF2. Use: PbF2 Refs: M. Nizam, Y. Bouteiller, B. Silvi, C. Pisani, M. Causą and R. Dovesi "A theoretical investigation of electronic structure and some thermodynamical properties of PbF2" J. Phys. C: Solid State Phys. 21, 5351 (1988) 282 2 DURAND 0 1 3 2.0 1.0 2.21543 0.16604 0.035015 1.07263 -0.56943 -0.086718 0.20836 0.87371 0.43138 0 1 1 0.0 1.0 0.08599 1.0 1.0